3-[2-[3-(2-methylsulfanylethylsulfonyl)propylamino]-2,3-dihydro-1H-inden-5-yl]-1H-pyridazin-6-one

Systemtic Name: 3-[2-[3-(2-methylsulfanylethylsulfonyl)propylamino]-2,3-dihydro-1H-inden-5-yl]-1H-pyridazin-6-one Openeye Name: 3-[2-[3-(2-methylsulfanylethylsulfonyl)propylamino]indan-5-yl]-1H-pyridazin-6-one CAS Name: 3-[2-[3-[2-(methylthio)ethylsulfonyl]propylamino]-2,3-dihydro-1H-inden-5-yl]-1H-pyridazin-6-one IUPAC Name: 3-[2-[3-(2-methylsulfanylethylsulfonyl)propylamino]-2,3-dihydro-1H-inden-5-yl]-1H-pyridazin-6-one Traditional Name: 3-[2-[3-[2-(methylthio)ethylsulfonyl]propylamino]indan-5-yl]-1H-pyridazin-6-one Formula: C19H25N3O3S2 MolecularWeight: 407.5501

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Descriptors Computed from Structure

Canonical SMILES:

CSCCS(=O)(=O)CCCNC1CC2=C(C1)C=C(C=C2)C3=NNC(=O)C=C3

Isomeric SMILES

CSCCS(=O)(=O)CCCNC1CC2=C(C1)C=C(C=C2)C3=NNC(=O)C=C3

InChI

InChI=1S/C19H25N3O3S2/c1-26-8-10-27(24,25)9-2-7-20-17-12-14-3-4-15(11-16(14)13-17)18-5-6-19(23)22-21-18/h3-6,11,17,20H,2,7-10,12-13H2,1H3,(H,22,23)